# generated using pymatgen
data_ScCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.11512965
_cell_length_b   10.11512965
_cell_length_c   10.11512931
_cell_angle_alpha   19.89581164
_cell_angle_beta   19.89581164
_cell_angle_gamma   19.89581164
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScCl
_chemical_formula_sum   'Sc2 Cl2'
_cell_volume   104.84252932
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Sc  Sc0  1  0.79080900  0.79080900  0.79080900  1.0
  Sc  Sc1  1  0.20919100  0.20919100  0.20919100  1.0
  Cl  Cl2  1  0.59752900  0.59752900  0.59752900  1.0
  Cl  Cl3  1  0.40247100  0.40247100  0.40247100  1.0